[(1R)-2-[3-(4-methoxyphenyl)propanoylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[3-(4-methoxyphenyl)propanoylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[3-(4-methoxyphenyl)propanoylamino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-[3-(4-methoxyphenyl)propanoylamino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[3-(4-methoxyphenyl)propanoylamino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C18H25N2O2S+ MolecularWeight: 333.4683

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)CCC1=CC=C(C=C1)OC)C2=CSC=C2

Isomeric SMILES

C[NH+](C)[C@@H](CNC(=O)CCC1=CC=C(C=C1)OC)C2=CSC=C2

InChI

InChI=1S/C18H24N2O2S/c1-20(2)17(15-10-11-23-13-15)12-19-18(21)9-6-14-4-7-16(22-3)8-5-14/h4-5,7-8,10-11,13,17H,6,9,12H2,1-3H3,(H,19,21)/p+1/t17-/m0/s1